%chk=000041709.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041709

0 1
 N  -8.4100001E-02  -1.555400       1.332100    
 C  -0.1899000     -0.6752000      0.1542000    
 C  -0.7475000      0.6845000      0.6550000    
 C    1.211900     -0.5445000     -0.5134000    
 C   -1.135500      -1.368800     -0.8683000    
 C  -0.9795000       1.734100     -0.4383000    
 C    2.305000      0.1196000      0.3335000    
 C   -2.536500      -1.698000     -0.3614000    
 C   -1.448100       3.054600      0.1565000    
 C    3.604200      0.2490000     -0.4498000    
 H   -1.698300      0.5260000       1.181700    
 H  -7.4900001E-02   1.106600       1.412900    
 H    1.565200      -1.545500     -0.7997000    
 H    1.111000      9.7000003E-03  -1.455700    
 H  -0.6784000      -2.310800      -1.202100    
 H   -1.226800     -0.7511000      -1.769900    
 H   -1.734600       1.384700      -1.149700    
 H  -5.7200000E-02   1.916300     -0.9990000    
 H    1.996700       1.122500      0.6445000    
 H    2.497300     -0.4634000       1.240100    
 H  -0.9833000      -1.617500       1.807700    
 H   0.5540000      -1.148300       2.014600    
 H   -3.075700     -0.8002000     -4.7400001E-02
 H   -3.117100      -2.161100      -1.166800    
 H   -2.517800      -2.407400      0.4706000    
 H   -2.388300       2.927200      0.7025000    
 H   -1.613200       3.789900     -0.6373000    
 H  -0.7016000       3.461600      0.8460000    
 H    4.373500      0.7225000      0.1684000    
 H    3.974600     -0.7333000     -0.7598000    
 H    3.463500      0.8626000      -1.345400    


%chk=000041709-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041709

0 1
N -0.018967 -1.615969 1.327217
C -0.187955 -0.684235 0.169639
C -0.759132 0.694913 0.647370
C 1.205356 -0.528816 -0.514295
C -1.136234 -1.380739 -0.855252
C -0.981014 1.778447 -0.434778
C 2.311016 0.174980 0.307307
C -2.575169 -1.662619 -0.369182
C -1.523425 3.096756 0.161082
C 3.658885 0.199432 -0.447953
H -1.721619 0.509607 1.168482
H -0.075986 1.100773 1.422443
H 1.552440 -1.548394 -0.774624
H 1.074930 0.018970 -1.469626
H -0.657663 -2.338884 -1.135172
H -1.179690 -0.762584 -1.773693
H -1.689267 1.405263 -1.200526
H -0.027899 1.980778 -0.962568
H 2.009096 1.213963 0.545578
H 2.457031 -0.342665 1.277424
H -0.906624 -1.819730 1.803090
H 0.678103 -1.282581 2.004641
H -3.112422 -0.735608 -0.096562
H -3.157295 -2.158923 -1.167414
H -2.589942 -2.339557 0.505633
H -2.490289 2.931419 0.673516
H -1.681845 3.862406 -0.620755
H -0.818949 3.513824 0.905637
H 4.446600 0.704094 0.141196
H 4.004923 -0.827598 -0.669578
H 3.561608 0.734180 -1.411976


